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Structure

Methyl 3-alpha,7-alpha-diacetoxy-12-oxo-5-beta-cholan-24-oate

CAS
28535-81-1
Catalog Number
ACM28535811
Category
Other Products
Molecular Weight
504.655460 [g/mol]
Molecular Formula
C29H44O7

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Specification

Synonyms
Oprea1_617208, Oprea1_745574, MolPort-001-932-116, NSC81205, EINECS 249-070-6, CID119834, BAS 00417547, Methyl 3-alpha,7-alpha-diacetoxy-12-oxo-5-beta-cholan-24-oate, 28535-81-1
IUPAC Name
methyl 4-(3,7-diacetyloxy-10,13-dimethyl-12-oxo-1,2,3,4,5,6,7,8,9,11,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl)pentanoate
Canonical SMILES
CC(CCC(=O)OC)C1CCC2C1(C(=O)CC3C2C(CC4C3(CCC(C4)OC(=O)C)C)OC(=O)C)C
InChI Key
GVIZCQOBODPSLY-UHFFFAOYSA-N
EC Number
249-070-6
Exact Mass
504.30900
H-Bond Acceptor
7
H-Bond Donor
0
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